(+)-Omeprazole
Properties
- Molecular formula
- C17H19N3O3S
- Molar mass
- 345.42 g/mol
- Exact mass
- 345.1147 Da
- logP
- 2.90Crippen estimate
- Polar surface area
- 77.1 Ų
- H-bond donors / acceptors
- 1 / 5
- Rotatable bonds
- 5
- Stereocentres
- Rin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
119141-89-8SMILES
COc1ccc2nc([S@](=O)Cc3ncc(C)c(OC)c3C)[nH]c2c1InChIKey
SUBDBMMJDZJVOS-XMMPIXPASA-NInChI
InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)/t24-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 1H-Benzimidazole, 6-methoxy-2-[(R)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-
- 1H-Benzimidazole-1-acetic acid, 5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-, (+)-
- 1H-Benzimidazole, 5-methoxy-2-[(R)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-
- 6-Methoxy-2-[(R)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole
- 1H-Benzimidazole, 5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-, (R)-
- (R)-Omeprazole
- (R)-5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole
- (R)-5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]sulfinyl]-1H-benzimidazole
- (R)-Esomeprazole
- R-Omeprazole
Work with (+)-Omeprazole
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
(S)-4-Desmethoxy-4-chloro omeprazole863029-89-480 % similar
5-Methoxy-2-[(3,5-dimethyl-2-pyridinyl)-methylsulfinyl]-benzimidazole110374-16-873 % similar
Tenatoprazole113712-98-470 % similar
5-Methoxy-2-[((4-methoxy-3,5-dimethyl-1-oxido-2-pyridinyl)methyl)sulfinyl]-benzimidazole176219-04-866 % similar
Omeprazole sulfide73590-85-966 % similar
Omeprazole sulfone88546-55-863 % similar
2-((6-Methoxy-1H-benzimidazole-2-sulfinyl)methyl)-3,5-dimethylpyridin-4(1H)-one301669-82-962 % similar
Esomeprazole sodium161796-78-760 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.